5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol

C6H5F5O — CID 21062455

IUPAC5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol
SMILESOC1(C(F)(F)F)C=CCC1(F)F
InChIInChI=1S/C6H5F5O/c7-5(8)3-1-2-4(5,12)6(9,10)11/h1-2,12H,3H2
InChIKeyFUHZAMAJSROGDP-UHFFFAOYSA-N
MW188.09 g/mol
LogP1.88
Rot. Bonds

About 5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol

5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol (PubChem CID 21062455) has the molecular formula C6H5F5O and a molecular weight of 188.09 g/mol. Its IUPAC name is 5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol.

Molecular Properties

Compound Name5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol
PubChem CID21062455
Molecular FormulaC6H5F5O
Molecular Weight188.09 g/mol
Exact Mass188.03
IUPAC Name5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol
SMILESOC1(C(F)(F)F)C=CCC1(F)F
InChIInChI=1S/C6H5F5O/c7-5(8)3-1-2-4(5,12)6(9,10)11/h1-2,12H,3H2
InChIKeyFUHZAMAJSROGDP-UHFFFAOYSA-N
XLogP1.88
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.09
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(Trifluoromethyl)cyclohex-2-en-1-ol
CID 10877484
1-Ethenylcyclopent-2-en-1-ol
CID 14271241
1,5,5-Tris(trifluoromethyl)cyclopent-2-en-1-ol
CID 21062412
2,2-Difluoro-1,3-bis(trifluoromethyl)cyclopent-4-ene-1,3-diol
CID 21062454
1,1,1,3,3,3-Hexafluoro-2-[2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopenta-1,3-dien-1-yl]propan-2-ol
CID 23528219
5-Fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol
CID 89202826
1,3-Bis(trifluoromethyl)cyclopent-4-ene-1,3-diol
CID 89202827
Ethane;1,5,5-tris(trifluoromethyl)cyclopent-2-en-1-ol
CID 91062180
1-(Trifluoromethyl)cyclopent-2-en-1-ol
CID 141208332
(1S)-1-(trifluoromethyl)cyclohex-2-en-1-ol
CID 93956554
(1R)-1-(trifluoromethyl)cyclohex-2-en-1-ol
CID 93956555
1-(Difluoromethyl)cyclohex-2-en-1-ol
CID 116005241

Frequently Asked Questions

What is the IUPAC name of 5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol?
The IUPAC name of 5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol (CID 21062455) is 5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol.
What is the SMILES notation for 5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol?
The canonical SMILES for 5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol is OC1(C(F)(F)F)C=CCC1(F)F.
What is the InChIKey of 5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol?
The InChIKey is FUHZAMAJSROGDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F5O/c7-5(8)3-1-2-4(5,12)6(9,10)11/h1-2,12H,3H2.
What are the key properties of 5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol?
5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol has a molecular weight of 188.09 g/mol, XLogP of 1.88, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol is sourced from PubChem (CID 21062455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).